Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one
TL;DR: Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one (CAS 117702-14-4) is a chemical compound with molecular formula C12H7N5O and molecular weight 237.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,8,12,13,14-pentazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,4,6,11,14,16-heptaen-9-one
Also Known As: Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one, Pyrido[2,1-b]-1,2,3-triazolo[4,5-f]quinazolin-12(1H)-one, 2-FLUORO-4-TRIFLUOROMETHYL-BENZENESULFONYL CHLORIDE, Pyrido[2,1-b][1,2,3]triazolo[4,5-f]quinazolin-12(2H)-one, RefChem:377293
| Molecular Formula | C12H7N5O |
|---|---|
| Molecular Weight | 237.07 g/mol |
| LogP | 1.119 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.06506 |
| Heavy Atoms | 18 |
| Complexity | 952.82214 |
Chemical Identifiers
| CAS Number | 117702-14-4 |
|---|---|
| SMILES | C1=CC2=NC3=C(C4=NNN=C4C=C3)C(=O)N2C=C1 |
Product Overview
Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one (CAS 117702-14-4), with molecular formula C12H7N5O and molecular weight 237.07 g/mol. IUPAC: 2,8,12,13,14-pentazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,4,6,11,14,16-heptaen-9-one.
Chemical Property Profile of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one
Property Insights of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one
The XLogP value of 1.119 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one. The TPSA of 75.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one. Following Lipinski's Rule of Five, Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one?
The CAS number of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one is 117702-14-4.
What is the molecular formula of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one?
The molecular formula of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one is C12H7N5O.
What is the molecular weight of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one?
The molecular weight of Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one is 237.07 g/mol.
Where can I buy Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one?
You can request a quote for Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.